| SpectraBase Compound ID | GIa3KM9ES8M |
|---|---|
| InChI | InChI=1S/C7H7NS/c1-3-7(2)4-5-9-6-8/h3,5H,1H2,2H3 |
| InChIKey | GQKMCYNHQLBDLU-UHFFFAOYSA-N |
| Mol Weight | 137.2 g/mol |
| Molecular Formula | C7H7NS |
| Exact Mass | 137.02992 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5zkUDnGobV2 |
|---|---|
| Name | 3-Methylpenta-1,2,4-trienyl thiocyanate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H7NS |
| InChI | InChI=1S/C7H7NS/c1-3-7(2)4-5-9-6-8/h3,5H,1H2,2H3 |
| InChIKey | GQKMCYNHQLBDLU-UHFFFAOYSA-N |
| Molecular Weight | 137.200 g/mol |
| SMILES | C(#N)SC=C=C(C=C)C |
| SPLASH | splash10-004i-9100000000-bc13394c9e79ed17f0ca |
| Source of Spectrum | K1-2001-1100-14 |
| Synonyms | thiocyanic acid 3-methylpenta-1,2,4-trienyl ester |
| Wiley ID | 846786 |